CID 12610330

39943-37-8

Structural Information

Molecular Formula
C9H17NO
SMILES
CN(C)CC1(CCCC1)C=O
InChI
InChI=1S/C9H17NO/c1-10(2)7-9(8-11)5-3-4-6-9/h8H,3-7H2,1-2H3
InChIKey
NEHVBXDPRDUMRT-UHFFFAOYSA-N
Compound name
1-[(dimethylamino)methyl]cyclopentane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

155.13101 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 136.7
[M+Na]+ 178.12023 145.4
[M+NH4]+ 173.16483 146.8
[M+K]+ 194.09417 139.6
[M-H]- 154.12373 138.6
[M+Na-2H]- 176.10568 142.6
[M]+ 155.13046 138.4
[M]- 155.13156 138.4
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