CID 4083675

1,1-dicyclopropyl-2-methylpropan-1-ol

Structural Information

Molecular Formula
C10H18O
SMILES
CC(C)C(C1CC1)(C2CC2)O
InChI
InChI=1S/C10H18O/c1-7(2)10(11,8-3-4-8)9-5-6-9/h7-9,11H,3-6H2,1-2H3
InChIKey
XWBOMKUVTDUGCZ-UHFFFAOYSA-N
Compound name
1,1-dicyclopropyl-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

154.13577 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.14305 140.3
[M+Na]+ 177.12499 146.5
[M-H]- 153.12849 146.2
[M+NH4]+ 172.16959 149.4
[M+K]+ 193.09893 145.3
[M+H-H2O]+ 137.13303 135.1
[M+HCOO]- 199.13397 157.4
[M+CH3COO]- 213.14962 190.1
[M+Na-2H]- 175.11044 143.7
[M]+ 154.13522 142.9
[M]- 154.13632 142.9
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