CID 54016362

1489162-37-9

Structural Information

Molecular Formula
C8H17NO
SMILES
CC1(CC(C1)(CN)CO)C
InChI
InChI=1S/C8H17NO/c1-7(2)3-8(4-7,5-9)6-10/h10H,3-6,9H2,1-2H3
InChIKey
KVXAUCCBQXOOPV-UHFFFAOYSA-N
Compound name
[1-(aminomethyl)-3,3-dimethylcyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

143.13101 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 135.2
[M+Na]+ 166.120228 141.2
[M-H]- 142.123734 137.5
[M+NH4]+ 161.164833 153.1
[M+K]+ 182.094168 142.6
[M+H-H2O]+ 126.128270 127.6
[M+HCOO]- 188.129211 155.5
[M+CH3COO]- 202.144861 178.7
[M+Na-2H]- 164.105676 140.8
[M]+ 143.13046142 141.7
[M]- 143.13155858 141.7
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