CID 13586013

N-(3-hydroxypropyl)formamide

Structural Information

Molecular Formula
C4H9NO2
SMILES
C(CNC=O)CO
InChI
InChI=1S/C4H9NO2/c6-3-1-2-5-4-7/h4,6H,1-3H2,(H,5,7)
InChIKey
WYRFKDCNTSFHBX-UHFFFAOYSA-N
Compound name
N-(3-hydroxypropyl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

332
Patents

103.06333 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 104.070606 118.7
[M+Na]+ 126.052548 125.7
[M-H]- 102.056054 117.8
[M+NH4]+ 121.097153 140.8
[M+K]+ 142.026488 125.3
[M+H-H2O]+ 86.060590 114.2
[M+HCOO]- 148.061531 143.3
[M+CH3COO]- 162.077181 166.2
[M+Na-2H]- 124.037996 126.5
[M]+ 103.06278142 118.6
[M]- 103.06387858 118.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe