CID 349252

N-(3-methoxypropyl)formamide

Structural Information

Molecular Formula
C5H11NO2
SMILES
COCCCNC=O
InChI
InChI=1S/C5H11NO2/c1-8-4-2-3-6-5-7/h5H,2-4H2,1H3,(H,6,7)
InChIKey
VTQINHDYJQCMGU-UHFFFAOYSA-N
Compound name
N-(3-methoxypropyl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

351
Patents

117.07898 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.08626 122.5
[M+Na]+ 140.06820 129.5
[M-H]- 116.07170 122.9
[M+NH4]+ 135.11280 144.8
[M+K]+ 156.04214 129.9
[M+H-H2O]+ 100.07624 117.7
[M+HCOO]- 162.07718 148.3
[M+CH3COO]- 176.09283 172.0
[M+Na-2H]- 138.05365 130.4
[M]+ 117.07843 124.8
[M]- 117.07953 124.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe