CID 108400

59848-69-0

Structural Information

Molecular Formula
C10H18O
SMILES
CC1=CCOC(C1)CC(C)C
InChI
InChI=1S/C10H18O/c1-8(2)6-10-7-9(3)4-5-11-10/h4,8,10H,5-7H2,1-3H3
InChIKey
GQJUQRHPTSAQNQ-UHFFFAOYSA-N
Compound name
4-methyl-2-(2-methylpropyl)-3,6-dihydro-2H-pyran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

154.13577 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.143046 135.2
[M+Na]+ 177.124988 140.9
[M-H]- 153.128494 139.0
[M+NH4]+ 172.169593 155.2
[M+K]+ 193.098928 141.3
[M+H-H2O]+ 137.133030 129.9
[M+HCOO]- 199.133971 154.9
[M+CH3COO]- 213.149621 179.0
[M+Na-2H]- 175.110436 140.1
[M]+ 154.13522142 134.4
[M]- 154.13631858 134.4
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