CID 22687

N,n-dipropylformamide

Structural Information

Molecular Formula
C7H15NO
SMILES
CCCN(CCC)C=O
InChI
InChI=1S/C7H15NO/c1-3-5-8(7-9)6-4-2/h7H,3-6H2,1-2H3
InChIKey
XFTIKWYXFSNCQF-UHFFFAOYSA-N
Compound name
N,N-dipropylformamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

6022
Patents

129.11537 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 128.9
[M+Na]+ 152.10459 135.3
[M-H]- 128.10809 130.5
[M+NH4]+ 147.14919 151.5
[M+K]+ 168.07853 136.1
[M+H-H2O]+ 112.11263 123.8
[M+HCOO]- 174.11357 154.3
[M+CH3COO]- 188.12922 179.7
[M+Na-2H]- 150.09004 135.0
[M]+ 129.11482 131.8
[M]- 129.11592 131.8
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