Nitrobenzyl alcohol → HCID 178421667, compound

HRID 354064Notes

Reaction equation

[N+]([CH:4](O)C1C=CC=CC=1)([O-])=O.C[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][O:28][P+:29]1([O-:41])[O:39][C:38]([CH3:40])=[C:37]2[C@H:32]([CH2:33][O:34][C:35]2=[O:36])[CH2:31][O:30]1>>[CH3:40][C:38]1[O:39][P+:29]([O:28][CH2:27][CH2:26][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][CH2:20][CH2:19][CH2:18][CH2:17][CH2:16][CH2:15][CH:14]([CH3:13])[CH3:4])([O-:41])[O:30][CH2:31][C@H:32]2[CH2:33][O:34][C:35](=[O:36])[C:37]=12

Participants

Reactant 2

HCID 21879777Nitrobenzyl alcohol

HCID 178443120HCID 178443120, compound

Product 1

HCID 178421667HCID 178421667, compound

Procedure

By high-resolution FAB mass spectrometry using a nitrobenzylalcohol matrix, the following molecular weight was found: 445.2721 amu, corresponding to (M+H)+ for cyclipostin P of C23H42O6P. From this, an empirical formula for cyclipostin P 2 of C23H41O6P resulted, molecular weight: 444. By electron spray mass spectrometry, in the positive ionization mode (ESI, positive) a peak at 445 amu, corresponding to (M+H)+ was found; moreover the characteristic peak at 221 amu, corresponding to C7H10O6P, was found. In the ESI negative mode, 443 amu (M−H)−, 321 amu (C16H34O4P) and 219 amu (C7H8O6P) were found.

Sources & evidence

ORD record: ord-e6b9ea427fb84828b96461e8ed76cdd5
Source dataset: uspto-grants-2004_06
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US06756402B2

Reaction notes

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