CID 89292965

2-[1-(hydroxymethyl)cyclopropyl]-n,n-dimethylacetamide

Structural Information

Molecular Formula
C8H15NO2
SMILES
CN(C)C(=O)CC1(CC1)CO
InChI
InChI=1S/C8H15NO2/c1-9(2)7(11)5-8(6-10)3-4-8/h10H,3-6H2,1-2H3
InChIKey
HXAZWFYYBRAJAN-UHFFFAOYSA-N
Compound name
2-[1-(hydroxymethyl)cyclopropyl]-N,N-dimethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

157.11028 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.117556 134.8
[M+Na]+ 180.099498 142.8
[M-H]- 156.103004 139.6
[M+NH4]+ 175.144103 152.5
[M+K]+ 196.073438 142.5
[M+H-H2O]+ 140.107540 130.2
[M+HCOO]- 202.108481 157.6
[M+CH3COO]- 216.124131 183.4
[M+Na-2H]- 178.084946 140.3
[M]+ 157.10973142 138.5
[M]- 157.11082858 138.5
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